CHEBI:43078 - hexane-1,6-diol

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ChEBI Name hexane-1,6-diol
ChEBI ID CHEBI:43078
Definition A diol that is hexane substituted by hydroxy groups at positions 1 and 6.
Stars This entity has been manually annotated by the ChEBI Team.
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Formula C6H14O2
Net Charge 0
Average Mass 118.17420
Monoisotopic Mass 118.099
InChI InChI=1S/C6H14O2/c7-5-3-1-2-4-6-8/h7-8H,1-6H2
InChIKey XXMIOPMDWAUFGU-UHFFFAOYSA-N
SMILES OCCCCCCO
ChEBI Ontology
Outgoing hexane-1,6-diol (CHEBI:43078) has parent hydride hexane (CHEBI:29021)
hexane-1,6-diol (CHEBI:43078) is a diol (CHEBI:23824)
hexane-1,6-diol (CHEBI:43078) is a primary alcohol (CHEBI:15734)
Incoming hexamidine (CHEBI:87184) has functional parent hexane-1,6-diol (CHEBI:43078)
IUPAC Name
hexane-1,6-diol
Synonyms Sources
1,6-Dihydroxyhexane ChemIDplus
1,6-Hexanediol ChemIDplus
6-hydroxy-1-hexanol ChEBI
alpha,omega-Hexanediol ChemIDplus
Hexamethylene glycol ChemIDplus
Hexamethylenediol ChemIDplus
Manual Xrefs Databases
1,6-Hexanediol Wikipedia
DB02210 DrugBank
HEZ PDBeChem
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Registry Numbers Types Sources
1633461 Reaxys Registry Number Reaxys
629-11-8 CAS Registry Number ChemIDplus
629-11-8 CAS Registry Number NIST Chemistry WebBook
Citations Waiting for Citations Types Sources
14904077 PubMed citation Europe PMC
21805184 PubMed citation Europe PMC
Last Modified
17 August 2015